################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 30317 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-1H TOCSY' . . . 30317 1 2 '2D NOESY' . . . 30317 1 3 '2D 1H-15N HSQC' . . . 30317 1 4 '2D 1H-13C HSQC' . . . 30317 1 5 '2D 1H-1H TOCSY' . . . 30317 1 6 '2D 1H-1H NOESY' . . . 30317 1 7 '2D 1H-13C HSQC' . . . 30317 1 8 '1D 1H' . . . 30317 1 9 '2D 1H-1H TOCSY' . . . 30317 1 10 '2D 1H-1H TOCSY' . . . 30317 1 11 '2D 1H-1H TOCSY' . . . 30317 1 12 '2D 1H-1H TOCSY' . . . 30317 1 13 '2D 1H-1H TOCSY' . . . 30317 1 14 '2D ECOSY' . . . 30317 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 ASP HA H 1 4.338 0.001 . . . . . . A 1 ASP HA . 30317 1 2 . 1 1 1 1 ASP HB2 H 1 2.762 0.001 . . . . . . A 1 ASP HB2 . 30317 1 3 . 1 1 1 1 ASP HB3 H 1 2.904 0.001 . . . . . . A 1 ASP HB3 . 30317 1 4 . 1 1 1 1 ASP CA C 13 53.258 0.000 . . . . . . A 1 ASP CA . 30317 1 5 . 1 1 1 1 ASP CB C 13 38.879 0.055 . . . . . . A 1 ASP CB . 30317 1 6 . 1 1 2 2 CYS H H 1 8.570 0.000 . . . . . . A 2 CYS H . 30317 1 7 . 1 1 2 2 CYS HA H 1 4.891 0.008 . . . . . . A 2 CYS HA . 30317 1 8 . 1 1 2 2 CYS HB2 H 1 3.139 0.001 . . . . . . A 2 CYS HB2 . 30317 1 9 . 1 1 2 2 CYS HB3 H 1 3.286 0.005 . . . . . . A 2 CYS HB3 . 30317 1 10 . 1 1 2 2 CYS CA C 13 54.516 0.000 . . . . . . A 2 CYS CA . 30317 1 11 . 1 1 2 2 CYS CB C 13 44.027 0.017 . . . . . . A 2 CYS CB . 30317 1 12 . 1 1 2 2 CYS N N 15 116.711 0.000 . . . . . . A 2 CYS N . 30317 1 13 . 1 1 3 3 LEU H H 1 8.498 0.003 . . . . . . A 3 LEU H . 30317 1 14 . 1 1 3 3 LEU HA H 1 3.932 0.007 . . . . . . A 3 LEU HA . 30317 1 15 . 1 1 3 3 LEU HB2 H 1 1.483 0.001 . . . . . . A 3 LEU HB2 . 30317 1 16 . 1 1 3 3 LEU HB3 H 1 1.734 0.001 . . . . . . A 3 LEU HB3 . 30317 1 17 . 1 1 3 3 LEU HG H 1 1.532 0.001 . . . . . . A 3 LEU HG . 30317 1 18 . 1 1 3 3 LEU HD11 H 1 1.075 0.002 . . . . . . A 3 LEU HD11 . 30317 1 19 . 1 1 3 3 LEU HD12 H 1 1.075 0.002 . . . . . . A 3 LEU HD12 . 30317 1 20 . 1 1 3 3 LEU HD13 H 1 1.075 0.002 . . . . . . A 3 LEU HD13 . 30317 1 21 . 1 1 3 3 LEU HD21 H 1 0.889 0.003 . . . . . . A 3 LEU HD21 . 30317 1 22 . 1 1 3 3 LEU HD22 H 1 0.889 0.003 . . . . . . A 3 LEU HD22 . 30317 1 23 . 1 1 3 3 LEU HD23 H 1 0.889 0.003 . . . . . . A 3 LEU HD23 . 30317 1 24 . 1 1 3 3 LEU CA C 13 54.082 0.000 . . . . . . A 3 LEU CA . 30317 1 25 . 1 1 3 3 LEU CB C 13 43.665 0.000 . . . . . . A 3 LEU CB . 30317 1 26 . 1 1 3 3 LEU CG C 13 26.230 0.000 . . . . . . A 3 LEU CG . 30317 1 27 . 1 1 3 3 LEU CD1 C 13 26.246 0.000 . . . . . . A 3 LEU CD1 . 30317 1 28 . 1 1 3 3 LEU CD2 C 13 22.232 0.000 . . . . . . A 3 LEU CD2 . 30317 1 29 . 1 1 3 3 LEU N N 15 120.911 0.000 . . . . . . A 3 LEU N . 30317 1 30 . 1 1 4 4 GLY H H 1 7.582 0.003 . . . . . . A 4 GLY H . 30317 1 31 . 1 1 4 4 GLY HA2 H 1 2.963 0.004 . . . . . . A 4 GLY HA2 . 30317 1 32 . 1 1 4 4 GLY HA3 H 1 2.876 0.002 . . . . . . A 4 GLY HA3 . 30317 1 33 . 1 1 4 4 GLY CA C 13 41.927 0.000 . . . . . . A 4 GLY CA . 30317 1 34 . 1 1 4 4 GLY N N 15 112.323 0.000 . . . . . . A 4 GLY N . 30317 1 35 . 1 1 5 5 PHE H H 1 8.291 0.003 . . . . . . A 5 PHE H . 30317 1 36 . 1 1 5 5 PHE HA H 1 3.955 0.010 . . . . . . A 5 PHE HA . 30317 1 37 . 1 1 5 5 PHE HB2 H 1 2.796 0.009 . . . . . . A 5 PHE HB2 . 30317 1 38 . 1 1 5 5 PHE HB3 H 1 2.983 0.002 . . . . . . A 5 PHE HB3 . 30317 1 39 . 1 1 5 5 PHE HD1 H 1 7.058 0.000 . . . . . . A 5 PHE HD1 . 30317 1 40 . 1 1 5 5 PHE HD2 H 1 7.058 0.000 . . . . . . A 5 PHE HD2 . 30317 1 41 . 1 1 5 5 PHE HE1 H 1 7.439 0.004 . . . . . . A 5 PHE HE1 . 30317 1 42 . 1 1 5 5 PHE HE2 H 1 7.439 0.004 . . . . . . A 5 PHE HE2 . 30317 1 43 . 1 1 5 5 PHE CA C 13 58.797 0.000 . . . . . . A 5 PHE CA . 30317 1 44 . 1 1 5 5 PHE CB C 13 39.033 0.008 . . . . . . A 5 PHE CB . 30317 1 45 . 1 1 5 5 PHE N N 15 118.531 0.000 . . . . . . A 5 PHE N . 30317 1 46 . 1 1 6 6 LEU H H 1 8.856 0.003 . . . . . . A 6 LEU H . 30317 1 47 . 1 1 6 6 LEU HA H 1 3.222 0.004 . . . . . . A 6 LEU HA . 30317 1 48 . 1 1 6 6 LEU HB2 H 1 0.886 0.004 . . . . . . A 6 LEU HB2 . 30317 1 49 . 1 1 6 6 LEU HB3 H 1 1.607 0.006 . . . . . . A 6 LEU HB3 . 30317 1 50 . 1 1 6 6 LEU HG H 1 0.200 0.018 . . . . . . A 6 LEU HG . 30317 1 51 . 1 1 6 6 LEU HD11 H 1 -0.281 0.005 . . . . . . A 6 LEU HD11 . 30317 1 52 . 1 1 6 6 LEU HD12 H 1 -0.281 0.005 . . . . . . A 6 LEU HD12 . 30317 1 53 . 1 1 6 6 LEU HD13 H 1 -0.281 0.005 . . . . . . A 6 LEU HD13 . 30317 1 54 . 1 1 6 6 LEU HD21 H 1 -0.525 0.006 . . . . . . A 6 LEU HD21 . 30317 1 55 . 1 1 6 6 LEU HD22 H 1 -0.525 0.006 . . . . . . A 6 LEU HD22 . 30317 1 56 . 1 1 6 6 LEU HD23 H 1 -0.525 0.006 . . . . . . A 6 LEU HD23 . 30317 1 57 . 1 1 6 6 LEU CB C 13 38.612 0.000 . . . . . . A 6 LEU CB . 30317 1 58 . 1 1 6 6 LEU CG C 13 24.993 0.000 . . . . . . A 6 LEU CG . 30317 1 59 . 1 1 6 6 LEU CD1 C 13 21.921 0.000 . . . . . . A 6 LEU CD1 . 30317 1 60 . 1 1 6 6 LEU CD2 C 13 25.100 0.000 . . . . . . A 6 LEU CD2 . 30317 1 61 . 1 1 6 6 LEU N N 15 120.816 0.000 . . . . . . A 6 LEU N . 30317 1 62 . 1 1 7 7 TRP H H 1 8.367 0.002 . . . . . . A 7 TRP H . 30317 1 63 . 1 1 7 7 TRP HA H 1 4.330 0.002 . . . . . . A 7 TRP HA . 30317 1 64 . 1 1 7 7 TRP HB2 H 1 3.246 0.007 . . . . . . A 7 TRP HB2 . 30317 1 65 . 1 1 7 7 TRP HB3 H 1 3.356 0.003 . . . . . . A 7 TRP HB3 . 30317 1 66 . 1 1 7 7 TRP HD1 H 1 7.162 0.005 . . . . . . A 7 TRP HD1 . 30317 1 67 . 1 1 7 7 TRP HE1 H 1 10.168 0.005 . . . . . . A 7 TRP HE1 . 30317 1 68 . 1 1 7 7 TRP HE3 H 1 7.804 0.001 . . . . . . A 7 TRP HE3 . 30317 1 69 . 1 1 7 7 TRP HZ2 H 1 7.557 0.001 . . . . . . A 7 TRP HZ2 . 30317 1 70 . 1 1 7 7 TRP HH2 H 1 7.314 0.001 . . . . . . A 7 TRP HH2 . 30317 1 71 . 1 1 7 7 TRP CA C 13 56.379 0.000 . . . . . . A 7 TRP CA . 30317 1 72 . 1 1 7 7 TRP CB C 13 28.688 0.000 . . . . . . A 7 TRP CB . 30317 1 73 . 1 1 7 7 TRP N N 15 122.420 0.000 . . . . . . A 7 TRP N . 30317 1 74 . 1 1 7 7 TRP NE1 N 15 129.674 0.000 . . . . . . A 7 TRP NE1 . 30317 1 75 . 1 1 8 8 LYS H H 1 8.326 0.002 . . . . . . A 8 LYS H . 30317 1 76 . 1 1 8 8 LYS HA H 1 4.729 0.014 . . . . . . A 8 LYS HA . 30317 1 77 . 1 1 8 8 LYS HB2 H 1 1.852 0.003 . . . . . . A 8 LYS HB2 . 30317 1 78 . 1 1 8 8 LYS HB3 H 1 1.943 0.002 . . . . . . A 8 LYS HB3 . 30317 1 79 . 1 1 8 8 LYS HG2 H 1 1.599 0.002 . . . . . . A 8 LYS HG2 . 30317 1 80 . 1 1 8 8 LYS HG3 H 1 1.599 0.002 . . . . . . A 8 LYS HG3 . 30317 1 81 . 1 1 8 8 LYS HD2 H 1 1.713 0.002 . . . . . . A 8 LYS HD2 . 30317 1 82 . 1 1 8 8 LYS HD3 H 1 1.713 0.002 . . . . . . A 8 LYS HD3 . 30317 1 83 . 1 1 8 8 LYS HE2 H 1 3.092 0.000 . . . . . . A 8 LYS HE2 . 30317 1 84 . 1 1 8 8 LYS HE3 H 1 3.092 0.000 . . . . . . A 8 LYS HE3 . 30317 1 85 . 1 1 8 8 LYS HZ1 H 1 7.554 0.002 . . . . . . A 8 LYS HZ1 . 30317 1 86 . 1 1 8 8 LYS HZ2 H 1 7.554 0.002 . . . . . . A 8 LYS HZ2 . 30317 1 87 . 1 1 8 8 LYS HZ3 H 1 7.554 0.002 . . . . . . A 8 LYS HZ3 . 30317 1 88 . 1 1 8 8 LYS CA C 13 57.023 0.000 . . . . . . A 8 LYS CA . 30317 1 89 . 1 1 8 8 LYS CB C 13 32.215 0.008 . . . . . . A 8 LYS CB . 30317 1 90 . 1 1 8 8 LYS CG C 13 24.887 0.000 . . . . . . A 8 LYS CG . 30317 1 91 . 1 1 8 8 LYS CD C 13 28.122 0.000 . . . . . . A 8 LYS CD . 30317 1 92 . 1 1 8 8 LYS N N 15 121.775 0.000 . . . . . . A 8 LYS N . 30317 1 93 . 1 1 9 9 CYS H H 1 8.293 0.002 . . . . . . A 9 CYS H . 30317 1 94 . 1 1 9 9 CYS HA H 1 4.894 0.002 . . . . . . A 9 CYS HA . 30317 1 95 . 1 1 9 9 CYS HB2 H 1 3.061 0.000 . . . . . . A 9 CYS HB2 . 30317 1 96 . 1 1 9 9 CYS HB3 H 1 3.061 0.000 . . . . . . A 9 CYS HB3 . 30317 1 97 . 1 1 9 9 CYS N N 15 118.266 0.000 . . . . . . A 9 CYS N . 30317 1 98 . 1 1 10 10 ASN H H 1 9.061 0.002 . . . . . . A 10 ASN H . 30317 1 99 . 1 1 10 10 ASN HA H 1 5.155 0.006 . . . . . . A 10 ASN HA . 30317 1 100 . 1 1 10 10 ASN HB2 H 1 2.765 0.006 . . . . . . A 10 ASN HB2 . 30317 1 101 . 1 1 10 10 ASN HB3 H 1 3.020 0.005 . . . . . . A 10 ASN HB3 . 30317 1 102 . 1 1 10 10 ASN HD21 H 1 7.739 0.001 . . . . . . A 10 ASN HD21 . 30317 1 103 . 1 1 10 10 ASN HD22 H 1 7.108 0.000 . . . . . . A 10 ASN HD22 . 30317 1 104 . 1 1 10 10 ASN CA C 13 48.372 0.000 . . . . . . A 10 ASN CA . 30317 1 105 . 1 1 10 10 ASN CB C 13 40.051 0.044 . . . . . . A 10 ASN CB . 30317 1 106 . 1 1 10 10 ASN N N 15 119.103 0.000 . . . . . . A 10 ASN N . 30317 1 107 . 1 1 11 11 PRO HA H 1 3.854 0.004 . . . . . . A 11 PRO HA . 30317 1 108 . 1 1 11 11 PRO HB2 H 1 2.007 0.005 . . . . . . A 11 PRO HB2 . 30317 1 109 . 1 1 11 11 PRO HB3 H 1 2.106 0.005 . . . . . . A 11 PRO HB3 . 30317 1 110 . 1 1 11 11 PRO HG2 H 1 1.885 0.006 . . . . . . A 11 PRO HG2 . 30317 1 111 . 1 1 11 11 PRO HG3 H 1 1.885 0.006 . . . . . . A 11 PRO HG3 . 30317 1 112 . 1 1 11 11 PRO HD2 H 1 3.858 0.012 . . . . . . A 11 PRO HD2 . 30317 1 113 . 1 1 11 11 PRO HD3 H 1 3.979 0.006 . . . . . . A 11 PRO HD3 . 30317 1 114 . 1 1 11 11 PRO CA C 13 64.766 0.000 . . . . . . A 11 PRO CA . 30317 1 115 . 1 1 11 11 PRO CB C 13 31.856 0.005 . . . . . . A 11 PRO CB . 30317 1 116 . 1 1 11 11 PRO CG C 13 27.747 0.000 . . . . . . A 11 PRO CG . 30317 1 117 . 1 1 11 11 PRO CD C 13 50.648 0.005 . . . . . . A 11 PRO CD . 30317 1 118 . 1 1 12 12 SER H H 1 7.801 0.002 . . . . . . A 12 SER H . 30317 1 119 . 1 1 12 12 SER HA H 1 4.423 0.005 . . . . . . A 12 SER HA . 30317 1 120 . 1 1 12 12 SER HB2 H 1 3.812 0.005 . . . . . . A 12 SER HB2 . 30317 1 121 . 1 1 12 12 SER HB3 H 1 3.921 0.003 . . . . . . A 12 SER HB3 . 30317 1 122 . 1 1 12 12 SER CA C 13 59.122 0.000 . . . . . . A 12 SER CA . 30317 1 123 . 1 1 12 12 SER CB C 13 63.183 0.042 . . . . . . A 12 SER CB . 30317 1 124 . 1 1 12 12 SER N N 15 110.477 0.000 . . . . . . A 12 SER N . 30317 1 125 . 1 1 13 13 ASN H H 1 7.596 0.001 . . . . . . A 13 ASN H . 30317 1 126 . 1 1 13 13 ASN HA H 1 4.642 0.003 . . . . . . A 13 ASN HA . 30317 1 127 . 1 1 13 13 ASN HB2 H 1 2.561 0.003 . . . . . . A 13 ASN HB2 . 30317 1 128 . 1 1 13 13 ASN HB3 H 1 2.665 0.005 . . . . . . A 13 ASN HB3 . 30317 1 129 . 1 1 13 13 ASN HD21 H 1 7.440 0.002 . . . . . . A 13 ASN HD21 . 30317 1 130 . 1 1 13 13 ASN HD22 H 1 6.792 0.001 . . . . . . A 13 ASN HD22 . 30317 1 131 . 1 1 13 13 ASN CA C 13 52.662 0.000 . . . . . . A 13 ASN CA . 30317 1 132 . 1 1 13 13 ASN CB C 13 37.453 0.005 . . . . . . A 13 ASN CB . 30317 1 133 . 1 1 13 13 ASN N N 15 120.982 0.000 . . . . . . A 13 ASN N . 30317 1 134 . 1 1 14 14 ASP H H 1 8.618 0.002 . . . . . . A 14 ASP H . 30317 1 135 . 1 1 14 14 ASP HA H 1 4.152 0.008 . . . . . . A 14 ASP HA . 30317 1 136 . 1 1 14 14 ASP HB2 H 1 2.542 0.003 . . . . . . A 14 ASP HB2 . 30317 1 137 . 1 1 14 14 ASP HB3 H 1 3.025 0.005 . . . . . . A 14 ASP HB3 . 30317 1 138 . 1 1 14 14 ASP CA C 13 54.185 0.000 . . . . . . A 14 ASP CA . 30317 1 139 . 1 1 14 14 ASP CB C 13 41.546 0.025 . . . . . . A 14 ASP CB . 30317 1 140 . 1 1 14 14 ASP N N 15 123.778 0.000 . . . . . . A 14 ASP N . 30317 1 141 . 1 1 15 15 LYS H H 1 7.987 0.002 . . . . . . A 15 LYS H . 30317 1 142 . 1 1 15 15 LYS HA H 1 4.657 0.004 . . . . . . A 15 LYS HA . 30317 1 143 . 1 1 15 15 LYS HB2 H 1 1.611 0.002 . . . . . . A 15 LYS HB2 . 30317 1 144 . 1 1 15 15 LYS HB3 H 1 2.371 0.002 . . . . . . A 15 LYS HB3 . 30317 1 145 . 1 1 15 15 LYS HG2 H 1 1.385 0.003 . . . . . . A 15 LYS HG2 . 30317 1 146 . 1 1 15 15 LYS HG3 H 1 1.385 0.003 . . . . . . A 15 LYS HG3 . 30317 1 147 . 1 1 15 15 LYS HD2 H 1 1.501 0.005 . . . . . . A 15 LYS HD2 . 30317 1 148 . 1 1 15 15 LYS HD3 H 1 1.501 0.005 . . . . . . A 15 LYS HD3 . 30317 1 149 . 1 1 15 15 LYS HE2 H 1 2.950 0.000 . . . . . . A 15 LYS HE2 . 30317 1 150 . 1 1 15 15 LYS HE3 H 1 2.950 0.000 . . . . . . A 15 LYS HE3 . 30317 1 151 . 1 1 15 15 LYS HZ1 H 1 7.486 0.004 . . . . . . A 15 LYS HZ1 . 30317 1 152 . 1 1 15 15 LYS HZ2 H 1 7.486 0.004 . . . . . . A 15 LYS HZ2 . 30317 1 153 . 1 1 15 15 LYS HZ3 H 1 7.486 0.004 . . . . . . A 15 LYS HZ3 . 30317 1 154 . 1 1 15 15 LYS CA C 13 54.297 0.000 . . . . . . A 15 LYS CA . 30317 1 155 . 1 1 15 15 LYS CB C 13 31.198 0.000 . . . . . . A 15 LYS CB . 30317 1 156 . 1 1 15 15 LYS N N 15 127.238 0.000 . . . . . . A 15 LYS N . 30317 1 157 . 1 1 16 16 CYS H H 1 9.202 0.001 . . . . . . A 16 CYS H . 30317 1 158 . 1 1 16 16 CYS HA H 1 4.889 0.006 . . . . . . A 16 CYS HA . 30317 1 159 . 1 1 16 16 CYS HB2 H 1 2.666 0.002 . . . . . . A 16 CYS HB2 . 30317 1 160 . 1 1 16 16 CYS HB3 H 1 2.788 0.000 . . . . . . A 16 CYS HB3 . 30317 1 161 . 1 1 16 16 CYS CA C 13 56.691 0.000 . . . . . . A 16 CYS CA . 30317 1 162 . 1 1 16 16 CYS CB C 13 38.803 0.011 . . . . . . A 16 CYS CB . 30317 1 163 . 1 1 16 16 CYS N N 15 122.223 0.000 . . . . . . A 16 CYS N . 30317 1 164 . 1 1 17 17 CYS H H 1 9.322 0.001 . . . . . . A 17 CYS H . 30317 1 165 . 1 1 17 17 CYS HA H 1 4.370 0.003 . . . . . . A 17 CYS HA . 30317 1 166 . 1 1 17 17 CYS HB2 H 1 2.685 0.008 . . . . . . A 17 CYS HB2 . 30317 1 167 . 1 1 17 17 CYS HB3 H 1 3.123 0.004 . . . . . . A 17 CYS HB3 . 30317 1 168 . 1 1 17 17 CYS CA C 13 52.779 0.000 . . . . . . A 17 CYS CA . 30317 1 169 . 1 1 17 17 CYS CB C 13 41.834 0.000 . . . . . . A 17 CYS CB . 30317 1 170 . 1 1 17 17 CYS N N 15 121.974 0.000 . . . . . . A 17 CYS N . 30317 1 171 . 1 1 18 18 ARG H H 1 8.734 0.003 . . . . . . A 18 ARG H . 30317 1 172 . 1 1 18 18 ARG HA H 1 4.340 0.007 . . . . . . A 18 ARG HA . 30317 1 173 . 1 1 18 18 ARG HB2 H 1 1.964 0.004 . . . . . . A 18 ARG HB2 . 30317 1 174 . 1 1 18 18 ARG HB3 H 1 1.964 0.004 . . . . . . A 18 ARG HB3 . 30317 1 175 . 1 1 18 18 ARG HG2 H 1 1.775 0.018 . . . . . . A 18 ARG HG2 . 30317 1 176 . 1 1 18 18 ARG HG3 H 1 1.779 0.019 . . . . . . A 18 ARG HG3 . 30317 1 177 . 1 1 18 18 ARG HD2 H 1 3.112 0.006 . . . . . . A 18 ARG HD2 . 30317 1 178 . 1 1 18 18 ARG HD3 H 1 3.300 0.003 . . . . . . A 18 ARG HD3 . 30317 1 179 . 1 1 18 18 ARG HE H 1 7.149 0.004 . . . . . . A 18 ARG HE . 30317 1 180 . 1 1 18 18 ARG CB C 13 32.201 0.000 . . . . . . A 18 ARG CB . 30317 1 181 . 1 1 18 18 ARG CG C 13 27.299 0.000 . . . . . . A 18 ARG CG . 30317 1 182 . 1 1 18 18 ARG CD C 13 42.546 0.007 . . . . . . A 18 ARG CD . 30317 1 183 . 1 1 18 18 ARG N N 15 125.425 0.000 . . . . . . A 18 ARG N . 30317 1 184 . 1 1 19 19 PRO HA H 1 4.533 0.005 . . . . . . A 19 PRO HA . 30317 1 185 . 1 1 19 19 PRO HB2 H 1 2.221 0.004 . . . . . . A 19 PRO HB2 . 30317 1 186 . 1 1 19 19 PRO HB3 H 1 2.329 0.007 . . . . . . A 19 PRO HB3 . 30317 1 187 . 1 1 19 19 PRO HG2 H 1 1.730 0.004 . . . . . . A 19 PRO HG2 . 30317 1 188 . 1 1 19 19 PRO HG3 H 1 1.968 0.003 . . . . . . A 19 PRO HG3 . 30317 1 189 . 1 1 19 19 PRO HD2 H 1 3.527 0.011 . . . . . . A 19 PRO HD2 . 30317 1 190 . 1 1 19 19 PRO HD3 H 1 3.535 0.016 . . . . . . A 19 PRO HD3 . 30317 1 191 . 1 1 19 19 PRO CA C 13 63.574 0.000 . . . . . . A 19 PRO CA . 30317 1 192 . 1 1 19 19 PRO CB C 13 35.002 0.016 . . . . . . A 19 PRO CB . 30317 1 193 . 1 1 19 19 PRO CG C 13 23.884 0.043 . . . . . . A 19 PRO CG . 30317 1 194 . 1 1 19 19 PRO CD C 13 50.193 0.009 . . . . . . A 19 PRO CD . 30317 1 195 . 1 1 20 20 ASN H H 1 8.483 0.002 . . . . . . A 20 ASN H . 30317 1 196 . 1 1 20 20 ASN HA H 1 4.798 0.003 . . . . . . A 20 ASN HA . 30317 1 197 . 1 1 20 20 ASN HB2 H 1 2.879 0.002 . . . . . . A 20 ASN HB2 . 30317 1 198 . 1 1 20 20 ASN HB3 H 1 2.951 0.003 . . . . . . A 20 ASN HB3 . 30317 1 199 . 1 1 20 20 ASN HD21 H 1 6.988 0.001 . . . . . . A 20 ASN HD21 . 30317 1 200 . 1 1 20 20 ASN HD22 H 1 6.099 0.002 . . . . . . A 20 ASN HD22 . 30317 1 201 . 1 1 20 20 ASN CA C 13 55.987 0.000 . . . . . . A 20 ASN CA . 30317 1 202 . 1 1 20 20 ASN CB C 13 39.107 0.038 . . . . . . A 20 ASN CB . 30317 1 203 . 1 1 20 20 ASN N N 15 118.023 0.000 . . . . . . A 20 ASN N . 30317 1 204 . 1 1 21 21 LEU H H 1 7.935 0.010 . . . . . . A 21 LEU H . 30317 1 205 . 1 1 21 21 LEU HA H 1 5.421 0.003 . . . . . . A 21 LEU HA . 30317 1 206 . 1 1 21 21 LEU HB2 H 1 0.957 0.006 . . . . . . A 21 LEU HB2 . 30317 1 207 . 1 1 21 21 LEU HB3 H 1 2.296 0.001 . . . . . . A 21 LEU HB3 . 30317 1 208 . 1 1 21 21 LEU HG H 1 0.883 0.005 . . . . . . A 21 LEU HG . 30317 1 209 . 1 1 21 21 LEU HD11 H 1 1.396 0.004 . . . . . . A 21 LEU HD11 . 30317 1 210 . 1 1 21 21 LEU HD12 H 1 1.396 0.004 . . . . . . A 21 LEU HD12 . 30317 1 211 . 1 1 21 21 LEU HD13 H 1 1.396 0.004 . . . . . . A 21 LEU HD13 . 30317 1 212 . 1 1 21 21 LEU HD21 H 1 0.240 0.002 . . . . . . A 21 LEU HD21 . 30317 1 213 . 1 1 21 21 LEU HD22 H 1 0.240 0.002 . . . . . . A 21 LEU HD22 . 30317 1 214 . 1 1 21 21 LEU HD23 H 1 0.240 0.002 . . . . . . A 21 LEU HD23 . 30317 1 215 . 1 1 21 21 LEU CA C 13 53.437 0.000 . . . . . . A 21 LEU CA . 30317 1 216 . 1 1 21 21 LEU CB C 13 45.961 0.020 . . . . . . A 21 LEU CB . 30317 1 217 . 1 1 21 21 LEU CG C 13 27.124 0.000 . . . . . . A 21 LEU CG . 30317 1 218 . 1 1 21 21 LEU CD1 C 13 24.296 0.000 . . . . . . A 21 LEU CD1 . 30317 1 219 . 1 1 21 21 LEU CD2 C 13 24.264 0.000 . . . . . . A 21 LEU CD2 . 30317 1 220 . 1 1 21 21 LEU N N 15 118.042 0.000 . . . . . . A 21 LEU N . 30317 1 221 . 1 1 22 22 VAL H H 1 8.963 0.002 . . . . . . A 22 VAL H . 30317 1 222 . 1 1 22 22 VAL HA H 1 4.296 0.002 . . . . . . A 22 VAL HA . 30317 1 223 . 1 1 22 22 VAL HB H 1 1.880 0.006 . . . . . . A 22 VAL HB . 30317 1 224 . 1 1 22 22 VAL HG11 H 1 0.888 0.004 . . . . . . A 22 VAL HG11 . 30317 1 225 . 1 1 22 22 VAL HG12 H 1 0.888 0.004 . . . . . . A 22 VAL HG12 . 30317 1 226 . 1 1 22 22 VAL HG13 H 1 0.888 0.004 . . . . . . A 22 VAL HG13 . 30317 1 227 . 1 1 22 22 VAL HG21 H 1 0.740 0.000 . . . . . . A 22 VAL HG21 . 30317 1 228 . 1 1 22 22 VAL HG22 H 1 0.740 0.000 . . . . . . A 22 VAL HG22 . 30317 1 229 . 1 1 22 22 VAL HG23 H 1 0.740 0.000 . . . . . . A 22 VAL HG23 . 30317 1 230 . 1 1 22 22 VAL CA C 13 60.902 0.000 . . . . . . A 22 VAL CA . 30317 1 231 . 1 1 22 22 VAL CB C 13 32.202 0.000 . . . . . . A 22 VAL CB . 30317 1 232 . 1 1 22 22 VAL CG1 C 13 20.915 0.000 . . . . . . A 22 VAL CG1 . 30317 1 233 . 1 1 22 22 VAL CG2 C 13 19.644 0.000 . . . . . . A 22 VAL CG2 . 30317 1 234 . 1 1 22 22 VAL N N 15 115.781 0.000 . . . . . . A 22 VAL N . 30317 1 235 . 1 1 23 23 CYS H H 1 9.420 0.001 . . . . . . A 23 CYS H . 30317 1 236 . 1 1 23 23 CYS HA H 1 4.576 0.003 . . . . . . A 23 CYS HA . 30317 1 237 . 1 1 23 23 CYS HB2 H 1 2.545 0.001 . . . . . . A 23 CYS HB2 . 30317 1 238 . 1 1 23 23 CYS HB3 H 1 3.184 0.004 . . . . . . A 23 CYS HB3 . 30317 1 239 . 1 1 23 23 CYS CA C 13 55.845 0.000 . . . . . . A 23 CYS CA . 30317 1 240 . 1 1 23 23 CYS CB C 13 37.740 0.046 . . . . . . A 23 CYS CB . 30317 1 241 . 1 1 23 23 CYS N N 15 125.898 0.000 . . . . . . A 23 CYS N . 30317 1 242 . 1 1 24 24 SER H H 1 7.977 0.005 . . . . . . A 24 SER H . 30317 1 243 . 1 1 24 24 SER HA H 1 4.362 0.006 . . . . . . A 24 SER HA . 30317 1 244 . 1 1 24 24 SER HB2 H 1 3.712 0.002 . . . . . . A 24 SER HB2 . 30317 1 245 . 1 1 24 24 SER HB3 H 1 3.910 0.002 . . . . . . A 24 SER HB3 . 30317 1 246 . 1 1 24 24 SER CA C 13 57.352 0.000 . . . . . . A 24 SER CA . 30317 1 247 . 1 1 24 24 SER CB C 13 63.298 0.060 . . . . . . A 24 SER CB . 30317 1 248 . 1 1 24 24 SER N N 15 123.708 0.000 . . . . . . A 24 SER N . 30317 1 249 . 1 1 25 25 ARG H H 1 8.853 0.002 . . . . . . A 25 ARG H . 30317 1 250 . 1 1 25 25 ARG HA H 1 3.777 0.002 . . . . . . A 25 ARG HA . 30317 1 251 . 1 1 25 25 ARG HB2 H 1 1.718 0.001 . . . . . . A 25 ARG HB2 . 30317 1 252 . 1 1 25 25 ARG HB3 H 1 1.816 0.001 . . . . . . A 25 ARG HB3 . 30317 1 253 . 1 1 25 25 ARG HG2 H 1 1.609 0.002 . . . . . . A 25 ARG HG2 . 30317 1 254 . 1 1 25 25 ARG HG3 H 1 1.609 0.002 . . . . . . A 25 ARG HG3 . 30317 1 255 . 1 1 25 25 ARG HD2 H 1 3.197 0.007 . . . . . . A 25 ARG HD2 . 30317 1 256 . 1 1 25 25 ARG HD3 H 1 3.197 0.007 . . . . . . A 25 ARG HD3 . 30317 1 257 . 1 1 25 25 ARG HE H 1 7.268 0.001 . . . . . . A 25 ARG HE . 30317 1 258 . 1 1 25 25 ARG CA C 13 56.890 0.000 . . . . . . A 25 ARG CA . 30317 1 259 . 1 1 25 25 ARG CB C 13 29.635 0.009 . . . . . . A 25 ARG CB . 30317 1 260 . 1 1 25 25 ARG CG C 13 28.104 0.000 . . . . . . A 25 ARG CG . 30317 1 261 . 1 1 25 25 ARG CD C 13 43.045 0.000 . . . . . . A 25 ARG CD . 30317 1 262 . 1 1 25 25 ARG N N 15 130.463 0.000 . . . . . . A 25 ARG N . 30317 1 263 . 1 1 26 26 LYS H H 1 7.787 0.001 . . . . . . A 26 LYS H . 30317 1 264 . 1 1 26 26 LYS HA H 1 4.059 0.002 . . . . . . A 26 LYS HA . 30317 1 265 . 1 1 26 26 LYS HB2 H 1 1.426 0.001 . . . . . . A 26 LYS HB2 . 30317 1 266 . 1 1 26 26 LYS HB3 H 1 1.648 0.005 . . . . . . A 26 LYS HB3 . 30317 1 267 . 1 1 26 26 LYS HG2 H 1 1.177 0.004 . . . . . . A 26 LYS HG2 . 30317 1 268 . 1 1 26 26 LYS HG3 H 1 1.285 0.002 . . . . . . A 26 LYS HG3 . 30317 1 269 . 1 1 26 26 LYS HE2 H 1 2.957 0.000 . . . . . . A 26 LYS HE2 . 30317 1 270 . 1 1 26 26 LYS HE3 H 1 2.957 0.000 . . . . . . A 26 LYS HE3 . 30317 1 271 . 1 1 26 26 LYS HZ1 H 1 7.502 0.001 . . . . . . A 26 LYS HZ1 . 30317 1 272 . 1 1 26 26 LYS HZ2 H 1 7.502 0.001 . . . . . . A 26 LYS HZ2 . 30317 1 273 . 1 1 26 26 LYS HZ3 H 1 7.502 0.001 . . . . . . A 26 LYS HZ3 . 30317 1 274 . 1 1 26 26 LYS CA C 13 57.877 0.000 . . . . . . A 26 LYS CA . 30317 1 275 . 1 1 26 26 LYS CB C 13 33.239 0.022 . . . . . . A 26 LYS CB . 30317 1 276 . 1 1 26 26 LYS CG C 13 24.480 0.022 . . . . . . A 26 LYS CG . 30317 1 277 . 1 1 26 26 LYS N N 15 116.089 0.000 . . . . . . A 26 LYS N . 30317 1 278 . 1 1 27 27 ASP H H 1 7.314 0.002 . . . . . . A 27 ASP H . 30317 1 279 . 1 1 27 27 ASP HA H 1 4.172 0.002 . . . . . . A 27 ASP HA . 30317 1 280 . 1 1 27 27 ASP HB2 H 1 0.572 0.003 . . . . . . A 27 ASP HB2 . 30317 1 281 . 1 1 27 27 ASP HB3 H 1 0.958 0.002 . . . . . . A 27 ASP HB3 . 30317 1 282 . 1 1 27 27 ASP CA C 13 55.200 0.000 . . . . . . A 27 ASP CA . 30317 1 283 . 1 1 27 27 ASP CB C 13 39.143 0.037 . . . . . . A 27 ASP CB . 30317 1 284 . 1 1 27 27 ASP N N 15 113.968 0.000 . . . . . . A 27 ASP N . 30317 1 285 . 1 1 28 28 LYS H H 1 8.074 0.002 . . . . . . A 28 LYS H . 30317 1 286 . 1 1 28 28 LYS HA H 1 3.703 0.002 . . . . . . A 28 LYS HA . 30317 1 287 . 1 1 28 28 LYS HB2 H 1 2.059 0.006 . . . . . . A 28 LYS HB2 . 30317 1 288 . 1 1 28 28 LYS HB3 H 1 2.270 0.002 . . . . . . A 28 LYS HB3 . 30317 1 289 . 1 1 28 28 LYS HG2 H 1 1.153 0.001 . . . . . . A 28 LYS HG2 . 30317 1 290 . 1 1 28 28 LYS HG3 H 1 1.153 0.001 . . . . . . A 28 LYS HG3 . 30317 1 291 . 1 1 28 28 LYS HD2 H 1 1.611 0.001 . . . . . . A 28 LYS HD2 . 30317 1 292 . 1 1 28 28 LYS HD3 H 1 1.674 0.000 . . . . . . A 28 LYS HD3 . 30317 1 293 . 1 1 28 28 LYS HZ1 H 1 7.493 0.003 . . . . . . A 28 LYS HZ1 . 30317 1 294 . 1 1 28 28 LYS HZ2 H 1 7.493 0.003 . . . . . . A 28 LYS HZ2 . 30317 1 295 . 1 1 28 28 LYS HZ3 H 1 7.493 0.003 . . . . . . A 28 LYS HZ3 . 30317 1 296 . 1 1 28 28 LYS CA C 13 57.659 0.000 . . . . . . A 28 LYS CA . 30317 1 297 . 1 1 28 28 LYS CB C 13 27.924 0.000 . . . . . . A 28 LYS CB . 30317 1 298 . 1 1 28 28 LYS CG C 13 25.512 0.000 . . . . . . A 28 LYS CG . 30317 1 299 . 1 1 28 28 LYS CD C 13 29.374 0.022 . . . . . . A 28 LYS CD . 30317 1 300 . 1 1 28 28 LYS N N 15 113.238 0.000 . . . . . . A 28 LYS N . 30317 1 301 . 1 1 29 29 TRP H H 1 6.708 0.001 . . . . . . A 29 TRP H . 30317 1 302 . 1 1 29 29 TRP HA H 1 5.581 0.002 . . . . . . A 29 TRP HA . 30317 1 303 . 1 1 29 29 TRP HB2 H 1 2.605 0.001 . . . . . . A 29 TRP HB2 . 30317 1 304 . 1 1 29 29 TRP HB3 H 1 3.036 0.004 . . . . . . A 29 TRP HB3 . 30317 1 305 . 1 1 29 29 TRP HD1 H 1 6.798 0.003 . . . . . . A 29 TRP HD1 . 30317 1 306 . 1 1 29 29 TRP HE1 H 1 10.158 0.005 . . . . . . A 29 TRP HE1 . 30317 1 307 . 1 1 29 29 TRP HE3 H 1 7.364 0.000 . . . . . . A 29 TRP HE3 . 30317 1 308 . 1 1 29 29 TRP HZ2 H 1 7.291 0.001 . . . . . . A 29 TRP HZ2 . 30317 1 309 . 1 1 29 29 TRP HZ3 H 1 7.080 0.001 . . . . . . A 29 TRP HZ3 . 30317 1 310 . 1 1 29 29 TRP CA C 13 55.846 0.000 . . . . . . A 29 TRP CA . 30317 1 311 . 1 1 29 29 TRP CB C 13 30.824 0.000 . . . . . . A 29 TRP CB . 30317 1 312 . 1 1 29 29 TRP N N 15 110.887 0.000 . . . . . . A 29 TRP N . 30317 1 313 . 1 1 29 29 TRP NE1 N 15 129.614 0.000 . . . . . . A 29 TRP NE1 . 30317 1 314 . 1 1 30 30 CYS H H 1 8.797 0.001 . . . . . . A 30 CYS H . 30317 1 315 . 1 1 30 30 CYS HA H 1 5.029 0.002 . . . . . . A 30 CYS HA . 30317 1 316 . 1 1 30 30 CYS HB2 H 1 2.678 0.002 . . . . . . A 30 CYS HB2 . 30317 1 317 . 1 1 30 30 CYS HB3 H 1 3.581 0.000 . . . . . . A 30 CYS HB3 . 30317 1 318 . 1 1 30 30 CYS CA C 13 54.789 0.000 . . . . . . A 30 CYS CA . 30317 1 319 . 1 1 30 30 CYS CB C 13 39.947 0.051 . . . . . . A 30 CYS CB . 30317 1 320 . 1 1 30 30 CYS N N 15 119.443 0.000 . . . . . . A 30 CYS N . 30317 1 321 . 1 1 31 31 LYS H H 1 9.482 0.002 . . . . . . A 31 LYS H . 30317 1 322 . 1 1 31 31 LYS HA H 1 5.145 0.007 . . . . . . A 31 LYS HA . 30317 1 323 . 1 1 31 31 LYS HB2 H 1 1.624 0.003 . . . . . . A 31 LYS HB2 . 30317 1 324 . 1 1 31 31 LYS HB3 H 1 2.076 0.004 . . . . . . A 31 LYS HB3 . 30317 1 325 . 1 1 31 31 LYS HG2 H 1 1.538 0.002 . . . . . . A 31 LYS HG2 . 30317 1 326 . 1 1 31 31 LYS HG3 H 1 1.538 0.002 . . . . . . A 31 LYS HG3 . 30317 1 327 . 1 1 31 31 LYS HD2 H 1 1.776 0.002 . . . . . . A 31 LYS HD2 . 30317 1 328 . 1 1 31 31 LYS HD3 H 1 1.776 0.002 . . . . . . A 31 LYS HD3 . 30317 1 329 . 1 1 31 31 LYS HE2 H 1 2.953 0.000 . . . . . . A 31 LYS HE2 . 30317 1 330 . 1 1 31 31 LYS HE3 H 1 2.953 0.000 . . . . . . A 31 LYS HE3 . 30317 1 331 . 1 1 31 31 LYS HZ1 H 1 7.500 0.003 . . . . . . A 31 LYS HZ1 . 30317 1 332 . 1 1 31 31 LYS HZ2 H 1 7.500 0.003 . . . . . . A 31 LYS HZ2 . 30317 1 333 . 1 1 31 31 LYS HZ3 H 1 7.500 0.003 . . . . . . A 31 LYS HZ3 . 30317 1 334 . 1 1 31 31 LYS CA C 13 54.388 0.000 . . . . . . A 31 LYS CA . 30317 1 335 . 1 1 31 31 LYS CB C 13 29.432 0.022 . . . . . . A 31 LYS CB . 30317 1 336 . 1 1 31 31 LYS CG C 13 24.548 0.000 . . . . . . A 31 LYS CG . 30317 1 337 . 1 1 31 31 LYS CD C 13 27.338 0.000 . . . . . . A 31 LYS CD . 30317 1 338 . 1 1 31 31 LYS N N 15 124.587 0.000 . . . . . . A 31 LYS N . 30317 1 339 . 1 1 32 32 TYR H H 1 8.290 0.009 . . . . . . A 32 TYR H . 30317 1 340 . 1 1 32 32 TYR HA H 1 4.947 0.002 . . . . . . A 32 TYR HA . 30317 1 341 . 1 1 32 32 TYR HB2 H 1 2.785 0.005 . . . . . . A 32 TYR HB2 . 30317 1 342 . 1 1 32 32 TYR HB3 H 1 3.115 0.009 . . . . . . A 32 TYR HB3 . 30317 1 343 . 1 1 32 32 TYR HD1 H 1 6.986 0.001 . . . . . . A 32 TYR HD1 . 30317 1 344 . 1 1 32 32 TYR HD2 H 1 6.986 0.001 . . . . . . A 32 TYR HD2 . 30317 1 345 . 1 1 32 32 TYR HE1 H 1 6.103 0.004 . . . . . . A 32 TYR HE1 . 30317 1 346 . 1 1 32 32 TYR HE2 H 1 6.103 0.004 . . . . . . A 32 TYR HE2 . 30317 1 347 . 1 1 32 32 TYR CA C 13 59.568 0.000 . . . . . . A 32 TYR CA . 30317 1 348 . 1 1 32 32 TYR CB C 13 38.230 0.016 . . . . . . A 32 TYR CB . 30317 1 349 . 1 1 32 32 TYR N N 15 117.994 0.000 . . . . . . A 32 TYR N . 30317 1 350 . 1 1 33 33 GLN H H 1 8.621 0.002 . . . . . . A 33 GLN H . 30317 1 351 . 1 1 33 33 GLN HA H 1 4.315 0.000 . . . . . . A 33 GLN HA . 30317 1 352 . 1 1 33 33 GLN HB2 H 1 1.908 0.004 . . . . . . A 33 GLN HB2 . 30317 1 353 . 1 1 33 33 GLN HB3 H 1 2.040 0.001 . . . . . . A 33 GLN HB3 . 30317 1 354 . 1 1 33 33 GLN HG2 H 1 2.283 0.002 . . . . . . A 33 GLN HG2 . 30317 1 355 . 1 1 33 33 GLN HG3 H 1 2.332 0.003 . . . . . . A 33 GLN HG3 . 30317 1 356 . 1 1 33 33 GLN HE21 H 1 7.406 0.001 . . . . . . A 33 GLN HE21 . 30317 1 357 . 1 1 33 33 GLN HE22 H 1 6.780 0.004 . . . . . . A 33 GLN HE22 . 30317 1 358 . 1 1 33 33 GLN CA C 13 56.375 0.000 . . . . . . A 33 GLN CA . 30317 1 359 . 1 1 33 33 GLN CB C 13 29.478 0.012 . . . . . . A 33 GLN CB . 30317 1 360 . 1 1 33 33 GLN CG C 13 33.332 0.006 . . . . . . A 33 GLN CG . 30317 1 361 . 1 1 33 33 GLN N N 15 123.105 0.000 . . . . . . A 33 GLN N . 30317 1 362 . 1 1 33 33 GLN NE2 N 15 111.344 0.000 . . . . . . A 33 GLN NE2 . 30317 1 363 . 1 1 34 34 ILE H H 1 8.130 0.002 . . . . . . A 34 ILE H . 30317 1 364 . 1 1 34 34 ILE HA H 1 4.300 0.007 . . . . . . A 34 ILE HA . 30317 1 365 . 1 1 34 34 ILE HB H 1 1.923 0.014 . . . . . . A 34 ILE HB . 30317 1 366 . 1 1 34 34 ILE HG12 H 1 1.456 0.009 . . . . . . A 34 ILE HG12 . 30317 1 367 . 1 1 34 34 ILE HG13 H 1 1.218 0.010 . . . . . . A 34 ILE HG13 . 30317 1 368 . 1 1 34 34 ILE HG21 H 1 0.946 0.004 . . . . . . A 34 ILE HG21 . 30317 1 369 . 1 1 34 34 ILE HG22 H 1 0.946 0.004 . . . . . . A 34 ILE HG22 . 30317 1 370 . 1 1 34 34 ILE HG23 H 1 0.946 0.004 . . . . . . A 34 ILE HG23 . 30317 1 371 . 1 1 34 34 ILE HD11 H 1 0.894 0.001 . . . . . . A 34 ILE HD11 . 30317 1 372 . 1 1 34 34 ILE HD12 H 1 0.894 0.001 . . . . . . A 34 ILE HD12 . 30317 1 373 . 1 1 34 34 ILE HD13 H 1 0.894 0.001 . . . . . . A 34 ILE HD13 . 30317 1 374 . 1 1 34 34 ILE CA C 13 59.760 0.000 . . . . . . A 34 ILE CA . 30317 1 375 . 1 1 34 34 ILE CB C 13 39.277 0.000 . . . . . . A 34 ILE CB . 30317 1 376 . 1 1 34 34 ILE CG1 C 13 27.308 0.007 . . . . . . A 34 ILE CG1 . 30317 1 377 . 1 1 34 34 ILE CG2 C 13 17.778 0.000 . . . . . . A 34 ILE CG2 . 30317 1 378 . 1 1 34 34 ILE CD1 C 13 13.300 0.000 . . . . . . A 34 ILE CD1 . 30317 1 379 . 1 1 34 34 ILE N N 15 123.501 0.000 . . . . . . A 34 ILE N . 30317 1 stop_ save_